- InChI
- InChI=1S/C7H3BrCl4O/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h1H3
- InChI Key
- YSVAURKXNCNUNS-UHFFFAOYSA-N
- Formula
- C7H3BrCl4O
- SMILES
- COc1c(Cl)c(Cl)c(Br)c(Cl)c1Cl
- Molecular Weight1
- 324.81
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -66.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -177.48 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.15 | kJ/mol | Joback Calculated Property |
| log10WS | -5.49 | Crippen Calculated Property | |
| logPoct/wat | 5.071 | Crippen Calculated Property | |
| McVol | 158.060 | ml/mol | McGowan Calculated Property |
| Pc | 3341.24 | kPa | Joback Calculated Property |
| Inp | 1836.00 | NIST | |
| Tboil | 649.44 | K | Joback Calculated Property |
| Tc | 901.50 | K | Joback Calculated Property |
| Tfus | 459.38 | K | Joback Calculated Property |
| Vc | 0.596 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [267.46; 299.26] | J/mol×K | [649.44; 901.50] | 
|
| Cp,gas | 267.46 | J/mol×K | 649.44 | Joback Calculated Property |
| Cp,gas | 273.83 | J/mol×K | 691.45 | Joback Calculated Property |
| Cp,gas | 279.78 | J/mol×K | 733.46 | Joback Calculated Property |
| Cp,gas | 285.30 | J/mol×K | 775.47 | Joback Calculated Property |
| Cp,gas | 290.39 | J/mol×K | 817.48 | Joback Calculated Property |
| Cp,gas | 295.05 | J/mol×K | 859.49 | Joback Calculated Property |
| Cp,gas | 299.26 | J/mol×K | 901.50 | Joback Calculated Property |
| η | [0.0002006; 0.0006472] | Pa×s | [459.38; 649.44] |
|
| η | 0.0006472 | Pa×s | 459.38 | Joback Calculated Property |
| η | 0.0004999 | Pa×s | 491.06 | Joback Calculated Property |
| η | 0.0003984 | Pa×s | 522.73 | Joback Calculated Property |
| η | 0.0003259 | Pa×s | 554.41 | Joback Calculated Property |
| η | 0.0002724 | Pa×s | 586.09 | Joback Calculated Property |
| η | 0.0002319 | Pa×s | 617.76 | Joback Calculated Property |
| η | 0.0002006 | Pa×s | 649.44 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Bromo-2,3,5,6-tetrachloroanisole.
Sources
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